2-(Aminomethyl)-N,N-diethylaniline

C₁₁H₁₈N₂CAS 334009-12-0178.28 g/mol

Open in Covalent MOL file

Primary amine Tertiary amine

Properties

Molecular formula: C₁₁H₁₈N₂
Molar mass: 178.28 g/mol
Exact mass: 178.1470 Da
logP: 1.99Crippen estimate
Polar surface area: 29.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

334009-12-0

SMILES

CCN(CC)C1=CC=CC=C1CN

InChIKey

XCALVTLLSKYQMH-UHFFFAOYSA-N

InChI

InChI=1S/C11H18N2/c1-3-13(4-2)11-8-6-5-7-10(11)9-12/h5-8H,3-4,9,12H2,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2-(Aminomethyl)-N,N-diethylaniline

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-[2-(Aminomethyl)(ethyl)anilino]-1-ethanol1178469-53-873 % similar 2-(Aminomethyl)-N,N-dipropylaniline1020969-90-768 % similar 2-(Aminomethyl)-N-cyclohexyl-N-ethylaniline1021237-25-158 % similar {2-[3,4-Dihydro-2(1H)-isoquinolinyl]-phenyl}methanamine937599-97-856 % similar N,N-Diethyl-o-toluidine606-46-252 % similar 2-(Aminomethyl)-N-butyl-N-methylaniline1020988-06-051 % similar 1-[2-(Aminomethyl)phenyl]-3-pyrrolidinol1220033-92-050 % similar 2-[2-(Aminomethyl)(methyl)anilino]-1-ethanol643087-97-249 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N1,N1-Dimethyl-N2-(phenylmethyl)-1,2-ethanediamine103-55-9

Elsewhere

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